(E)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-(5-bromanyl-2-fluoranyl-phenyl)-N-methyl-prop-2-enamide

Systemtic Name: (E)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-(5-bromanyl-2-fluoranyl-phenyl)-N-methyl-prop-2-enamide Openeye Name: (E)-N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-3-(5-bromo-2-fluoro-phenyl)-N-methyl-prop-2-enamide CAS Name: (E)-N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-(5-bromo-2-fluorophenyl)-N-methyl-2-propenamide IUPAC Name: (E)-N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-(5-bromo-2-fluorophenyl)-N-methylprop-2-enamide Traditional Name: (E)-N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-3-(5-bromo-2-fluoro-phenyl)-N-methyl-acrylamide Formula: C21H18BrFN4O3 MolecularWeight: 473.295023

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C21H18BrFN4O3/c1-26(17(28)10-7-14-11-15(22)8-9-16(14)23)18-19(24)27(21(30)25-20(18)29)12-13-5-3-2-4-6-13/h2-11H,12,24H2,1H3,(H,25,29,30)/b10-7+